(Q105215652)

English

[(1R,2R,6S,9R,12R,13R,15R,17S,18R,19R,20R)-19-Acetyloxy-17-(furan-3-yl)-8,8,12,18-tetramethyl-4,11-dioxo-7,14-dioxahexacyclo[10.8.0.02,6.02,9.013,15.013,18]icosan-20-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

[19-Acetyloxy-17-(furan-3-yl)-8,8,12,18-tetramethyl-4,11-dioxo-7,14-dioxahexacyclo[10.8.0.02,6.02,9.013,15.013,18]icosan-20-yl] acetate

1 reference

based on heuristic

inferred from SMILES

mass

540.235932732 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₃₆O₉

0 references

canonical SMILES

O=C(OC1C(OC(=O)C)C2(C)C(C3=COC=C3)CC4OC42C5(C(=O)CC6C(OC7CC(=O)CC76C15)(C)C)C)C

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isomeric SMILES

CC(=O)O[C@@H]1[C@@H]2[C@@]34CC(=O)C[C@@H]3OC(C)(C)[C@@H]4CC(=O)[C@@]2(C)[C@@]23O[C@@H]2C[C@@H](c2ccoc2)[C@]3(C)[C@H]1OC(C)=O

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found in taxon

Turraea wakefieldii

1 reference

stated in

Ring A-seco mosquito larvicidal limonoids from Turraea wakefieldii

Identifiers

InChI

InChI=1S/C30H36O9/c1-14(31)36-23-24-28(6,20(34)11-19-26(3,4)38-21-9-17(33)12-29(19,21)24)30-22(39-30)10-18(16-7-8-35-13-16)27(30,5)25(23)37-15(2)32/h7-8,13,18-19,21-25H,9-12H2,1-6H3/t18-,19-,21-,22+,23+,24-,25-,27+,28+,29+,30+/m0/s1

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InChIKey

PVWOAELREUNHIO-OFOYKKCZSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

PVWOAELREUNHIO-OFOYKKCZSA-N

1 reference

(Q105215652)

[(1R,2R,6S,9R,12R,13R,15R,17S,18R,19R,20R)-19-Acetyloxy-17-(furan-3-yl)-8,8,12,18-tetramethyl-4,11-dioxo-7,14-dioxahexacyclo[10.8.0.02,6.02,9.013,15.013,18]icosan-20-yl] acetate

Statements

Identifiers

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